Geometry & MOs

Info

ID:	20304
PubChem CID:	583023
Reduced:	N2F4O5H8C13 (1)
Stoich.:	A2B4C5D8E13 (1)
Weight, g/mol:	348.036934
ΔH_f, kcal/mol:	-263.05
Dipole, Da:	6.68
IP(EA), eV:	-10.08(-1.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(6-nitroquinolin-8-yl) 2,3,3,3-tetrafluoro-2-methoxypropanoate

Drug info:

PubChemData

Smile

COC(C(=O)OC1=C2C(=CC(=C1)[N+](=O)[O-])C=CC=N2)(C(F)(F)F)F

DOS

IR

Vibrations